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82326-40-7 | 1H-Benzimidazole,2-(2-naphthalenylmethyl)-
CAS No: 82326-40-7 Catalog No: AG008KKR MDL No:
Product Description
Catalog Number:
AG008KKR
Chemical Name:
1H-Benzimidazole,2-(2-naphthalenylmethyl)-
CAS Number:
82326-40-7
Molecular Formula:
C18H14N2
Molecular Weight:
258.3172
IUPAC Name:
2-(naphthalen-2-ylmethyl)-1H-benzimidazole
InChI:
InChI=1S/C18H14N2/c1-2-6-15-11-13(9-10-14(15)5-1)12-18-19-16-7-3-4-8-17(16)20-18/h1-11H,12H2,(H,19,20)
InChI Key:
TXUQJAOFDMFKDK-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)cc(cc2)Cc1nc2c([nH]1)cccc2
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.324g/mol
Monoisotopic Mass:
258.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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